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5-nitro-2,3-dihydro-1H-indole

5-nitro-2,3-dihydro-1H-indole

CAS: 32692-19-6

Formula: C8H8N2O2

SMILES: [O-][N+](=O)C1=CC=C2NCCC2=C1

IUPAC: 5-nitro-2,3-dihydro-1H-indole

InChI: InChI=1S/C8H8N2O2/c11-10(12)7-1-2-8-6(5-7)3-4-9-8/h1-2,5,9H,3-4H2

Composition: C (58.53%), H (4.91%), N (17.06%), O (19.49%)

Molar Mass: 164.164

Atom Count: 20

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 164.058577506
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey WJQWYAJTPPYORB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.88
Topological Polar Surface Area 55.17
Polarizability 16.23
Ring Count 2
Rotatable Bond Count 1

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